Mrv0541 12061315522D          

 19 21  0  0  0  0            999 V2000
    3.5341   -1.1944    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1216   -0.4799    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5341    0.2345    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.3591    0.2346    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.7716   -0.4799    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.3591   -1.1944    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.6094   -0.4800    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    6.0195    0.2301    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.7716   -1.9088    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
    2.2966   -0.4800    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8189   -1.1377    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
    1.0457   -0.8865    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0456   -0.0736    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8187    0.1776    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.3313   -1.2991    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3832   -0.8867    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3833   -0.0738    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3311    0.3388    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1150   -1.3094    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  2  3  1  0  0  0  0
  3  4  2  0  0  0  0
  4  5  1  0  0  0  0
  5  6  2  0  0  0  0
  1  6  1  0  0  0  0
  5  7  1  0  0  0  0
  7  8  1  0  0  0  0
  6  9  1  0  0  0  0
  2 10  1  0  0  0  0
 10 11  1  0  0  0  0
 11 12  1  0  0  0  0
 12 13  1  0  0  0  0
 13 14  1  0  0  0  0
 10 14  2  0  0  0  0
 12 15  2  0  0  0  0
 15 16  1  0  0  0  0
 16 17  2  0  0  0  0
 17 18  1  0  0  0  0
 13 18  2  0  0  0  0
 16 19  1  0  0  0  0
M  ISO  1   9  18
M  END
> <ID>
CHEBI:76611

> <NAME>
flutemetamol ((18)F)

> <DEFINITION>
A member of the class of benzothiazoles that is 1,3-benzothiazole substituted by 3-(18F)fluoro-4-(methylamino)phenyl and hydroxy groups at positions 3 and 6 respectively. A positron emission tomography imaging ligand for the detection of amyloid aggregation associated with Alzheimer disease.

> <STAR>
3

> <SYNONYM>
Flutemetamol F18; Flutemetamol F-18; Flutemetamol F 18; Flutemetamol; 18F-Flutemetamol

> <IUPAC_NAME>
2-[3-((18)F)fluoro-4-(methylamino)phenyl]-1,3-benzothiazol-6-ol

> <INN>
flutemetamol ((18)F)

> <BRAND_NAME>
Vizamyl

> <FORMULA>
C14H11[18F]N2OS

> <MASS>
273.320

> <MONOISOTOPIC_MASS>
273.06015

> <CHARGE>
0

> <SMILES>
CNc1ccc(cc1[18F])-c1nc2ccc(O)cc2s1

> <INCHI>
InChI=1S/C14H11FN2OS/c1-16-11-4-2-8(6-10(11)15)14-17-12-5-3-9(18)7-13(12)19-14/h2-7,16,18H,1H3/i15-1

> <INCHIKEY>
VVECGOCJFKTUAX-HUYCHCPVSA-N

> <CAS_REGISTRY_NUMBER>
765922-62-1

> <REAXYS_REGISTRY_NUMBER>
9498222

> <CHEMIDPLUS>
765922-62-1

> <KEGG_DRUG_ACCESSION>
D10231

> <WIKIPEDIA_ACCESSION>
Flutemetamol_(18F)

> <PUBMED_CITATION>
19617318; 20687209; 21683932; 21747004; 22301718; 22878921; 23285496; 23398333; 23740104; 24296542

$$$$